4-[[4-(2,3-dimethylphenyl)piperazin-1-yl]-[1-(thiophen-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]methyl]-N,N-dimethyl-aniline

Systemtic Name: 4-[[4-(2,3-dimethylphenyl)piperazin-1-yl]-[1-(thiophen-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]methyl]-N,N-dimethyl-aniline Openeye Name: 4-[[4-(2,3-dimethylphenyl)piperazin-1-yl]-[1-(2-thienylmethyl)tetrazol-5-yl]methyl]-N,N-dimethyl-aniline CAS Name: 4-[[4-(2,3-dimethylphenyl)-1-piperazinyl]-[1-(thiophen-2-ylmethyl)-5-tetrazolyl]methyl]-N,N-dimethylaniline IUPAC Name: 4-[[4-(2,3-dimethylphenyl)piperazin-1-yl]-[1-(thiophen-2-ylmethyl)tetrazol-5-yl]methyl]-N,N-dimethylaniline Traditional Name: [4-[[4-(2,3-dimethylphenyl)piperazino]-[1-(2-thenyl)tetrazol-5-yl]methyl]phenyl]-dimethyl-amine Formula: C27H33N7S MolecularWeight: 487.66282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(C3=CC=C(C=C3)N(C)C)C4=NN=NN4CC5=CC=CS5)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(C3=CC=C(C=C3)N(C)C)C4=NN=NN4CC5=CC=CS5)C

InChI

InChI=1S/C27H33N7S/c1-20-7-5-9-25(21(20)2)32-14-16-33(17-15-32)26(22-10-12-23(13-11-22)31(3)4)27-28-29-30-34(27)19-24-8-6-18-35-24/h5-13,18,26H,14-17,19H2,1-4H3